2-chloro-6-iodo-N-methoxybenzamide

C8H7ClINO2 — CID 131106200

IUPAC2-chloro-6-iodo-N-methoxybenzamide
SMILESCONC(=O)c1c(Cl)cccc1I
InChIInChI=1S/C8H7ClINO2/c1-13-11-8(12)7-5(9)3-2-4-6(7)10/h2-4H,1H3,(H,11,12)
InChIKeyZYOJAIYZVYWFQV-UHFFFAOYSA-N
MW311.51 g/mol
LogP2.24
Rot. Bonds2

About 2-chloro-6-iodo-N-methoxybenzamide

2-chloro-6-iodo-N-methoxybenzamide (PubChem CID 131106200) has the molecular formula C8H7ClINO2 and a molecular weight of 311.51 g/mol. Its IUPAC name is 2-chloro-6-iodo-N-methoxybenzamide.

Molecular Properties

Compound Name2-chloro-6-iodo-N-methoxybenzamide
PubChem CID131106200
Molecular FormulaC8H7ClINO2
Molecular Weight311.51 g/mol
Exact Mass310.92
IUPAC Name2-chloro-6-iodo-N-methoxybenzamide
SMILESCONC(=O)c1c(Cl)cccc1I
InChIInChI=1S/C8H7ClINO2/c1-13-11-8(12)7-5(9)3-2-4-6(7)10/h2-4H,1H3,(H,11,12)
InChIKeyZYOJAIYZVYWFQV-UHFFFAOYSA-N
XLogP2.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.51
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N-methoxy-2-methylbenzamide
CID 107097630
N-(1-bicyclo[1.1.1]pentanyl)-2-chloro-6-iodobenzamide
CID 172646915
3-(2-chloro-6-fluorophenyl)-N-methoxy-5-methyl-1,2-oxazole-4-carboxamide
CID 51279290
methyl 2-amino-6-chlorobenzoate;hydrochloride
CID 84819290
2,6-dichloro-N-(2-methoxyphenyl)benzamide
CID 853872
methyl 2-iodo-6-methoxybenzoate
CID 91882308
methyl 2-chloro-6-hydrazinylbenzoate
CID 67291363
methyl 2-amino-6-chloro-3-iodobenzoate
CID 126738254
2-chloro-6-(1-cyclohexylidene-4-methoxybutan-2-yl)-N-methoxybenzamide
CID 78096214
N-(2-amino-5-methoxyphenyl)-2,6-dichlorobenzamide
CID 63257918
3-(2-chlorophenyl)sulfanyl-N-methoxypropanamide
CID 60700895
2,6-dichloro-N-cyclopentyloxybenzamide
CID 83216790

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-iodo-N-methoxybenzamide?
The IUPAC name of 2-chloro-6-iodo-N-methoxybenzamide (CID 131106200) is 2-chloro-6-iodo-N-methoxybenzamide.
What is the SMILES notation for 2-chloro-6-iodo-N-methoxybenzamide?
The canonical SMILES for 2-chloro-6-iodo-N-methoxybenzamide is CONC(=O)c1c(Cl)cccc1I.
What is the InChIKey of 2-chloro-6-iodo-N-methoxybenzamide?
The InChIKey is ZYOJAIYZVYWFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClINO2/c1-13-11-8(12)7-5(9)3-2-4-6(7)10/h2-4H,1H3,(H,11,12).
What are the key properties of 2-chloro-6-iodo-N-methoxybenzamide?
2-chloro-6-iodo-N-methoxybenzamide has a molecular weight of 311.51 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-iodo-N-methoxybenzamide is sourced from PubChem (CID 131106200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).